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1460-43-1 | Benzenemethanol, 3-amino-2,4,6-triiodo-
CAS No: 1460-43-1 Catalog No: AG001DLQ MDL No:
Product Description
Catalog Number:
AG001DLQ
Chemical Name:
Benzenemethanol, 3-amino-2,4,6-triiodo-
CAS Number:
1460-43-1
Molecular Formula:
C7H6I3NO
Molecular Weight:
500.8420
IUPAC Name:
(3-amino-2,4,6-triiodophenyl)methanol
InChI:
InChI=1S/C7H6I3NO/c8-4-1-5(9)7(11)6(10)3(4)2-12/h1,12H,2,11H2
InChI Key:
VZQXILUNJAYEEK-UHFFFAOYSA-N
SMILES:
OCc1c(I)cc(c(c1I)N)I
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
500.758g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
500.844g/mol
Monoisotopic Mass:
500.758g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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